Ru GTH-PBE-q8
    1    0    7
     0.61211332    1     5.04489332
    3
     0.64215040    2     4.62556355    -1.80334903
                                        2.32811359
     0.67936654    2     3.23395238    -2.42101064
                                        2.86457842
     0.38059720    2   -15.53165455    13.58045054
                                      -15.39878349
